dimethyl-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]oxyphenyl]sulfanium

Systemtic Name: dimethyl-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]oxyphenyl]sulfanium Openeye Name: [4-[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]oxyphenyl]-dimethyl-sulfonium CAS Name: dimethyl-[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropoxy]phenyl]sulfonium IUPAC Name: dimethyl-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxyphenyl]sulfanium Traditional Name: [4-[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]oxyphenyl]-dimethyl-sulfonium Formula: C22H28NO4S+ MolecularWeight: 402.52702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)[S+](C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)[S+](C)C

InChI

InChI=1S/C22H27NO4S/c1-22(2,3)27-21(25)23-19(15-16-9-7-6-8-10-16)20(24)26-17-11-13-18(14-12-17)28(4)5/h6-14,19H,15H2,1-5H3/p+1